SCHEMBL17290174

SCHEMBL17290174

COC(=O)Cc1ccc(Oc2nc(-c3ccc(Cl)s3)nc3c2CCC3)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.41
▸ PDE4B Q07343 7/20 0.41
▸ PDE4D Q08499 4/20 0.39
▸ APP P05067 2/20 0.38
▸ THRB P10828 1/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MMP9 P14780 1/20 0.37
▸ MAPT P10636 1/20 0.35
▸ BCHE P06276 2/20 0.35
▸ ACHE P22303 2/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17290147 0.90 LMNA (0.39) LMNAPDE4BPDE4DAPPTHRB
SCHEMBL17290172 0.89 PDE4B (0.47) LMNAPDE4BPDE4DMAPTBCHE
SCHEMBL17290176 0.89 LMNA (0.39) LMNAPDE4BPDE4DAPPTHRB
SCHEMBL17290157 0.89 PDE4B (0.38) LMNAPDE4BPDE4DAPPTHRB
SCHEMBL17290175 0.88 PDE4B (0.48) LMNAPDE4BPDE4DMAPTBCHE
SCHEMBL17290093 0.88 LMNA (0.41) LMNAPDE4BPDE4DTHRBNPC1
SCHEMBL17290188 0.87 PDE4B (0.39) LMNAPDE4BPDE4DAPPTHRB
SCHEMBL17290153 0.87 PDE4B (0.40) LMNAPDE4BPDE4DAPPTHRB
SCHEMBL17290136 0.87 LMNA (0.39) LMNAPDE4BPDE4DAPPTHRB
SCHEMBL17290100 0.87 LMNA (0.39) LMNAPDE4BPDE4DAPPTHRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9670189-B2 Substituted condensed pyrimidine compounds Grünenthal GmbH (DE) 2017-06-06 — — US disclosed
EP-2951173-B1 NOVEL SUBSTITUTED CONDENSED PYRIMIDINE COMPOUNDS GRUENENTHAL GMBH (DE) 2017-05-17 — — EP disclosed
US-20150344496-A1 NOVEL SUBSTITUTED CONDENSED PYRIMIDINE COMPOUNDS Grünenthal GmbH (DE) 2015-12-03 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150344496-A1 NOVEL SUBSTITUTED CONDENSED PYRIMIDINE COMPOUNDS TYMP, PDE4A, DPYD LMNA 2348/4885PDE4B 4/4885PDE4D 8/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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